SCHEMBL5066616

SCHEMBL5066616

C=CC(=O)OCCOC(=O)C1CC2C=CC1C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.45
KMT2A Q03164 2/20 0.45
TSHR P16473 5/20 0.43
TP53 P04637 2/20 0.43
HIF1A Q16665 2/20 0.43
HSD17B10 Q99714 2/20 0.43
RAB9A P51151 1/20 0.43
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 2/20 0.41
HPGD P15428 2/20 0.41
APEX1 P27695 1/20 0.41
RECQL P46063 1/20 0.41
BLM P54132 1/20 0.41
ESR2 Q92731 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP3A4 P08684 1/20 0.40
THRB P10828 2/20 0.38
MAPK1 P28482 2/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16766588 0.88 ALDH1A1 (0.43) ALDH1A1KMT2ATSHRTP53HIF1A
SCHEMBL10388301 0.87 ALDH1A1 (0.53) ALDH1A1KMT2ATSHRHSD17B10RAB9A
SCHEMBL13897067 0.87 ALDH1A1 (0.53) ALDH1A1KMT2ATSHRHSD17B10RAB9A
SCHEMBL14213298 0.87 ALDH1A1 (0.53) ALDH1A1KMT2ATSHRHSD17B10RAB9A
SCHEMBL32688638 0.84 ALDH1A1 (0.43) ALDH1A1KMT2ATSHRHSD17B10RAB9A
SCHEMBL17107938 0.83 ALDH1A1 (0.50) ALDH1A1KMT2ATSHRHSD17B10RAB9A
SCHEMBL4402661 0.83 ALDH1A1 (0.50) ALDH1A1KMT2ATSHRHSD17B10RAB9A
SCHEMBL14216898 0.81 KDM4E (0.46) ALDH1A1KMT2ATSHRHSD17B10RAB9A
SCHEMBL32688976 0.81 ALDH1A1 (0.42) ALDH1A1KMT2ATSHRHSD17B10RAB9A
SCHEMBL19498813 0.81 LMNA (0.49) ALDH1A1KMT2ATSHRHSD17B10RAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150158271-A1 CROSSLINKABLE RESIN MOLDED BODY, CROSSLINKED RESIN MOLDED BODY, AND LAMINATE ZEON CORPORATION (JP) 2015-06-11 US disclosed
EP-1655321-B1 POLYMERIZABLE COMPOSITIONS AND MOLDED ARTICLES PRODUCED BY USING THE SAME ZEON CORP (JP) 2012-11-21 EP disclosed
US-7381782-B2 Polymerizable composition and molded articles produced by using the same ZEON CORPORATION (JP) 2008-06-03 US disclosed
US-20060258828-A1 Polymerizable composition and molded articles produced by using the same ZEON CORPORATION (JP) 2006-11-16 US disclosed
EP-1655321-A1 POLYMERIZABLE COMPOSITIONS AND MOLDED ARTICLES PRODUCED BY USING THE SAME Zeon Corporation (JP) 2006-05-10 EP disclosed